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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H22O8
Molecular Weight 414.4061
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5,8,8A,9-TETRAHYDRO-5-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-9-METHOXY-FURO(3',4':6,7)NAPHTHO(2,3-D)-1,3-DIOXOL-6(5AH)-ONE, (5R-(5.ALPHA.,5A.BETA.,8A.ALPHA.,9.BETA.))-

SMILES

COc1cc(cc(c1O)OC)[C@]2([H])c3cc4c(cc3[C@]([H])([C@@]5([H])COC(=O)[C@@]52[H])OC)OCO4

InChI

InChIKey=AMTKNUDRCUERFP-DXRQPORESA-N
InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)20(16)23)18-11-6-14-15(30-9-29-14)7-12(11)21(27-3)13-8-28-22(24)19(13)18/h4-7,13,18-19,21,23H,8-9H2,1-3H3/t13-,18+,19-,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H22O8
Molecular Weight 414.4061
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 16:20:15 UTC 2021
Edited
by admin
on Sat Jun 26 16:20:15 UTC 2021
Record UNII
UY5BXI2HZ5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5,8,8A,9-TETRAHYDRO-5-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-9-METHOXY-FURO(3',4':6,7)NAPHTHO(2,3-D)-1,3-DIOXOL-6(5AH)-ONE, (5R-(5.ALPHA.,5A.BETA.,8A.ALPHA.,9.BETA.))-
Systematic Name English
(5R,5AR,8AR,9S)-5-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-9-METHOXY-5,8,8A,9-TETRAHYDRO(2)BENZOFURO(5,6-F)(1,3)BENZODIOXOL-6(5AH)-ONE
Systematic Name English
FURO(3',4':6,7)NAPHTHO(2,3-D)-1,3-DIOXOL-6(5AH)-ONE, 5,8,8A,9-TETRAHYDRO-5-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-9-METHOXY-, (5R-(5.ALPHA.,5A.BETA.,8A.ALPHA.,9.BETA.))-
Systematic Name English
ETOPOSIDE IMPURITY J [EP]
Common Name English
Code System Code Type Description
PUBCHEM
15621809
Created by admin on Sat Jun 26 16:20:15 UTC 2021 , Edited by admin on Sat Jun 26 16:20:15 UTC 2021
PRIMARY
CAS
118356-05-1
Created by admin on Sat Jun 26 16:20:15 UTC 2021 , Edited by admin on Sat Jun 26 16:20:15 UTC 2021
PRIMARY
FDA UNII
UY5BXI2HZ5
Created by admin on Sat Jun 26 16:20:15 UTC 2021 , Edited by admin on Sat Jun 26 16:20:15 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> IMPURITY